CID 55254387

(6-fluoro-1,2-benzoxazol-3-yl)methanamine hydrochloride

Structural Information

Molecular Formula
C8H7FN2O
SMILES
C1=CC2=C(C=C1F)ON=C2CN
InChI
InChI=1S/C8H7FN2O/c9-5-1-2-6-7(4-10)11-12-8(6)3-5/h1-3H,4,10H2
InChIKey
VLOWYMFNFSVUDD-UHFFFAOYSA-N
Compound name
(6-fluoro-1,2-benzoxazol-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

166.05424 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.06152 129.6
[M+Na]+ 189.04346 142.5
[M+NH4]+ 184.08806 138.0
[M+K]+ 205.01740 138.4
[M-H]- 165.04696 131.9
[M+Na-2H]- 187.02891 135.6
[M]+ 166.05369 132.0
[M]- 166.05479 132.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe